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[NO2-(15)-N]-5-NITRO-4-IMIDAZOLECARBOXAMIDE

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[NO2-(15)-N]-5-NITRO-4-IMIDAZOLECARBOXAMIDE
SpectraBase Compound ID E7JvNhGcwLU
InChI InChI=1S/C4H4N4O3/c5-3(9)2-4(8(10)11)7-1-6-2/h1H,(H2,5,9)(H,6,7)/i8+1
InChIKey YJHHUXIIKAYKJJ-VJJZLTLGSA-N
Mol Weight 157.09 g/mol
Molecular Formula C4H4N315NO3
Exact Mass 157.025375 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgQExeR1FsS
Name [NO2-(15)-N]-5-NITRO-4-IMIDAZOLECARBOXAMIDE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H4N315NO3
InChI InChI=1S/C4H4N4O3/c5-3(9)2-4(8(10)11)7-1-6-2/h1H,(H2,5,9)(H,6,7)/i8+1
InChIKey YJHHUXIIKAYKJJ-VJJZLTLGSA-N
Literature Reference Author M.L.JAIN,Y.P.TSAO,N.L.HO,J.W.CHENG
Literature Reference Citation J.ORG.CHEM.,66,6472(2001)
Literature Reference DOI 10.1021/jo010253q
Solvent DMSO-D6
Source File Reference UWVN24780